SCHEMBL14624313

SCHEMBL14624313

CN1CCN(CCCNI)CC1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PAOX Q6QHF9 1/20 0.42
SIGMAR1 Q99720 1/20 0.40
TP53 P04637 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
KMT2A Q03164 2/20 0.39
CSNK2A2 P19784 1/20 0.38
CSNK2B P67870 1/20 0.38
CSNK2A1 P68400 1/20 0.38
CSNK2A3 Q8NEV1 1/20 0.38
USP2 O75604 2/20 0.38
ACE2 Q9BYF1 1/20 0.37
KDM4E B2RXH2 1/20 0.36
HSD17B10 Q99714 1/20 0.36
ALDH1A1 P00352 1/20 0.36
HPGD P15428 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL19966100 0.86 CARM1 (0.41) PAOXSIGMAR1ACE2ALDH1A1
SCHEMBL21386205 0.81 HRH3 (0.52) SMN1; SMN2
SCHEMBL4392341 0.81 ACE2 (0.50) PAOXSIGMAR1TP53SMN1; SMN2KMT2A
SCHEMBL14824991 0.79 HRH3 (0.56) SMN1; SMN2
SCHEMBL1269079 0.79 CARM1 (0.50) PAOXSIGMAR1TP53SMN1; SMN2KMT2A
SCHEMBL6429155 0.77 PAOX (0.42) PAOXSIGMAR1TP53SMN1; SMN2KMT2A
SCHEMBL4760025 0.77 PAOX (0.42) PAOXSIGMAR1TP53SMN1; SMN2KMT2A
SCHEMBL6663287 0.77 PAOX (0.60) PAOXSIGMAR1CSNK2A2CSNK2BCSNK2A1
SCHEMBL6657767 0.77 PAOX (0.54) PAOXSIGMAR1CSNK2A2CSNK2BCSNK2A1
SCHEMBL20234244 0.77 PAOX (0.60) PAOXSIGMAR1CSNK2A2CSNK2BCSNK2A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007008895-A1 KINASE INHIBITORS ALLERGAN, INC. (US) 2007-01-18 WO disclosed